(5R)-3-[[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenyl-imidazolidine-2,4-dione

Systemtic Name: (5R)-3-[[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenyl-imidazolidine-2,4-dione Openeye Name: (5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenyl-imidazolidine-2,4-dione CAS Name: (5R)-3-[[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]methyl]-5-methyl-5-phenylimidazolidine-2,4-dione IUPAC Name: (5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenylimidazolidine-2,4-dione Traditional Name: (5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenyl-hydantoin Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)C[NH+]2CCC(CC2)C(=O)N3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCC(CC2)C(=O)N3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H32N4O3/c1-23(19-9-5-4-6-10-19)21(29)27(22(30)24-23)17-25-15-11-18(12-16-25)20(28)26-13-7-2-3-8-14-26/h4-6,9-10,18H,2-3,7-8,11-17H2,1H3,(H,24,30)/p+1/t23-/m1/s1